Information card for entry 4121723

Structure parameters

• Formula: C37 H33 B O2 Si2
• Calculated formula: C37 H33 B O2 Si2
• Title of publication: Selective boryl silyl ether formation in the photoreaction of bisboryloxide/boroxine with hydrosilane catalyzed by a transition-metal carbonyl complex.
• Authors of publication: Ito, Masaki; Itazaki, Masumi; Nakazawa, Hiroshi
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 17
• Pages of publication: 6183 - 6186
• a: 11.0778 ± 0.0016 Å
• b: 15.267 ± 0.002 Å
• c: 18.537 ± 0.003 Å
• α: 90°
• β: 91.017 ± 0.003°
• γ: 90°
• Cell volume: 3134.6 ± 0.8 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.1275
• Goodness-of-fit parameter for all reflections included in the refinement: 1.192
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No